ethyl 2-[5-(4-chlorophenyl)-2-(phenylcarbamoyl)-3,4-dihydropyrazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-chlorophenyl)-2-(phenylcarbamoyl)-3,4-dihydropyrazol-4-yl]ethanoate Openeye Name: ethyl 2-[5-(4-chlorophenyl)-2-(phenylcarbamoyl)-3,4-dihydropyrazol-4-yl]acetate CAS Name: 2-[2-[anilino(oxo)methyl]-5-(4-chlorophenyl)-3,4-dihydropyrazol-4-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-chlorophenyl)-2-(phenylcarbamoyl)-3,4-dihydropyrazol-4-yl]acetate Traditional Name: 2-[3-(4-chlorophenyl)-1-(phenylcarbamoyl)-2-pyrazolin-4-yl]acetic acid ethyl ester Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H20ClN3O3/c1-2-27-18(25)12-15-13-24(20(26)22-17-6-4-3-5-7-17)23-19(15)14-8-10-16(21)11-9-14/h3-11,15H,2,12-13H2,1H3,(H,22,26)